7-[(1S,2S)-2-[(E)-7-methyloct-1-enyl]cyclopentyl]heptaneperoxoic acid

Systemtic Name: 7-[(1S,2S)-2-[(E)-7-methyloct-1-enyl]cyclopentyl]heptaneperoxoic acid Openeye Name: 7-[(1S,2S)-2-[(E)-7-methyloct-1-enyl]cyclopentyl]heptaneperoxoic acid CAS Name: 7-[(1S,2S)-2-[(E)-7-methyloct-1-enyl]cyclopentyl]heptaneperoxoic acid IUPAC Name: 7-[(1S,2S)-2-[(E)-7-methyloct-1-enyl]cyclopentyl]heptaneperoxoic acid Traditional Name: 7-[(1S,2S)-2-[(E)-7-methyloct-1-enyl]cyclopentyl]peroxyenanthic acid Formula: C21H38O3 MolecularWeight: 338.52462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCC=CC1CCCC1CCCCCCC(=O)OO

Isomeric SMILES

CC(C)CCCC/C=C/[C@H]1CCC[C@@H]1CCCCCCC(=O)OO

InChI

InChI=1S/C21H38O3/c1-18(2)12-7-3-4-8-13-19-15-11-16-20(19)14-9-5-6-10-17-21(22)24-23/h8,13,18-20,23H,3-7,9-12,14-17H2,1-2H3/b13-8+/t19-,20-/m0/s1